Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | HGFAC | Q04756 | 1/20 | 0.56 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28193616 | 0.88 | HSD17B10 (0.61) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL28193618 | 0.87 | HSD17B10 (0.59) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL28463968 | 0.85 | KMT2A (0.58) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL29130743 | 0.85 | HGFAC (0.62) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL28668870 | 0.84 | HSD17B10 (0.53) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL1268183 | 0.83 | ALDH1A1 (0.51) | KMT2AMEN1PKMMAPTALDH1A1 | |
| SCHEMBL29745346 | 0.83 | ALDH1A1 (0.51) | KMT2AMEN1PKMMAPTALDH1A1 | |
| SCHEMBL11221123 | 0.83 | HSD17B10 (0.54) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL3859353 | 0.81 | HSD17B10 (0.53) | HSD17B10HGFACPDE7AKMT2AMEN1 | |
| SCHEMBL11644221 | 0.81 | KMT2A (0.54) | HSD17B10HGFACPDE7AKMT2AMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6583309-B1 | Such as 1-(5-Amino-1-(3-(1-aminomethyl-4-guanidino-butyl)-ureidomethyl)-pentyl)-3-(5-guanidino-2-ureido-pentyl)-urea | UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY | 2003-06-24 | — | — | US | disclosed |
| US-6420591-B1 | ANTICARCINOGENIC AGENTS AND VIRICIDES | UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY | 2002-07-16 | — | — | US | disclosed |